SCHEMBL9322932

SCHEMBL9322932

[CH2]C(OCCOCC)OCCOCC

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
TSHR P16473 1/20 0.37
THRB P10828 2/20 0.37
LMNA P02545 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4650815 0.95 ALDH1A1 (0.36) ALDH1A1TSHRTHRBLMNA
SCHEMBL1083645 0.87 ALDH1A1 (0.35) ALDH1A1TSHRTHRB
SCHEMBL28483314 0.85 ALDH1A1 (0.33) ALDH1A1TSHRTHRB
SCHEMBL11432743 0.81
SCHEMBL28218401 0.79
SCHEMBL27297448 0.79
SCHEMBL21858866 0.79 ALDH1A1 (0.36) ALDH1A1TSHRTHRBLMNA
SCHEMBL28799965 0.79 ALDH1A1 (0.36) ALDH1A1TSHRTHRB
SCHEMBL29268385 0.79 LMNA (0.35) THRBLMNA
SCHEMBL29127452 0.77 TSHR (0.46) ALDH1A1TSHRTHRB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5369078-A Lightfast DAI NIPPON PRINTING CO., LTD. (JP) 1994-11-29 US disclosed